Compound	Neocalyxins B
NPACT-Id	NPACT00805
IUPAC	naphthalene-1,4-dione
Synonyms	1,4-NAPHTHOQUINONE;1,4-Naphthalenedione;NAPHTHOQUINONE;p-Naphthoquinone;alpha-Naphthoquinone;1,4-Naphthylquinone;naphthalene-1,4-dione;a-naphthoquinone;1,4-Dihydro-1,4-diketonaphthalene;1,4-diketonaphthalene;1,4-NAPHTHOQUINOLINE
PubChem Id	8530
Class	Flavonoid
In-vitro anticancer activity	2 cancer cell lines
In-Vivo anticancer activity	No
Targets	No targets found
Properties	Physical Elemental Topological
InChi Key	FRASJONUBLZVQX-UHFFFAOYSA-N
InChi	1S/C10H6O2/c11-9-5-6-10(12)8-4-2-1-3-7(8)9/h1-6H
SMILES	O=C1c2c(C(=O)C=C1)cccc2
SMART	[H]C1=C([H])C([H])=C2C(=O)C([H])=C([H])C(=O)C2=C1[H]
CAS No.	130-15-4
Structure Download
Cross Refrence in other databases
	Super Natural	-
	CTD	-
	HIT	-
	NCI-60 GI₅₀ data	-
Suppliers	AAA Chemistry, ABI Chem, AKos Consulting & Solutions, Ambinter, ChemExper Chemical Directory, ChemFrog, Chemical Synthesis Database, ChemMol, IS Chemical Technology, Jamson Pharmachem Technology, MolPort, MP Biomedicals, R&D Chemicals, Sigma-Aldrich, TCI (Tokyo Chemical Industry), Vitas-M Laboratory, ZINC,
Drug-Likeliness Filters	Lipinski's rule of five	Yes
	Ghose filter	No
	Veber filter	Yes
	Muegge Filter	No
Similarity Search	Human metabolite database	FDA approved drugs

NPACT

Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase